PUBCHEM-ZINC04098583 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 0.5130 1.6370 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 0.1370 -0.1210 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1600 -0.6130 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 -1.7390 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -1.1300 -1.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2460 -1.8870 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -0.4180 -1.5610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0680 -1.1740 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 0.5910 -2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 0.9580 -2.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -0.2180 -1.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 0.3880 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.1400 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 1.8400 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 2.1530 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 1.9500 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 0.0850 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -0.9700 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -2.0660 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -2.5950 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 0.3520 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -1.2220 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 0.2570 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 0.9550 -3.2290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 M CHG 1 2 1 M CHG 1 24 -1 M END